4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1697-1563 |
| Compound Name: | 4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 447.2 |
| Molecular Formula: | C16 H11 Br N6 O5 |
| Smiles: | CC1\C(C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O)=N/Nc1ccc(cc1[Br])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4334 |
| logD: | 4.4256 |
| logSw: | -4.3772 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.627 |
| InChI Key: | FBBILGJWYZRBSV-UHFFFAOYSA-N |